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Details

Stereochemistry RACEMIC
Molecular Formula C7H14
Molecular Weight 98.1861
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYL-1-HEXENE

SMILES

CCC(C)CC=C

InChI

InChIKey=SUWJESCICIOQHO-UHFFFAOYSA-N
InChI=1S/C7H14/c1-4-6-7(3)5-2/h4,7H,1,5-6H2,2-3H3

HIDE SMILES / InChI

Molecular Formula C7H14
Molecular Weight 98.1861
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 03:32:05 GMT 2025
Edited
by admin
on Wed Apr 02 03:32:05 GMT 2025
Record UNII
BNE36XR1GQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-HEXENE, 4-METHYL-
Preferred Name English
4-METHYL-1-HEXENE
Systematic Name English
(±)-4-METHYL-1-HEXENE
Systematic Name English
NSC-73926
Code English
Code System Code Type Description
EPA CompTox
DTXSID40863272
Created by admin on Wed Apr 02 03:32:05 GMT 2025 , Edited by admin on Wed Apr 02 03:32:05 GMT 2025
PRIMARY
FDA UNII
BNE36XR1GQ
Created by admin on Wed Apr 02 03:32:05 GMT 2025 , Edited by admin on Wed Apr 02 03:32:05 GMT 2025
PRIMARY
CAS
3769-23-1
Created by admin on Wed Apr 02 03:32:05 GMT 2025 , Edited by admin on Wed Apr 02 03:32:05 GMT 2025
PRIMARY
ECHA (EC/EINECS)
223-202-2
Created by admin on Wed Apr 02 03:32:05 GMT 2025 , Edited by admin on Wed Apr 02 03:32:05 GMT 2025
PRIMARY
PUBCHEM
19589
Created by admin on Wed Apr 02 03:32:05 GMT 2025 , Edited by admin on Wed Apr 02 03:32:05 GMT 2025
PRIMARY
NSC
73926
Created by admin on Wed Apr 02 03:32:05 GMT 2025 , Edited by admin on Wed Apr 02 03:32:05 GMT 2025
PRIMARY
Related Record Type Details
INNOVATOR->PARENT
ENANTIOMER -> RACEMATE